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physics.chem-ph2024
Milestoning network refinement by incorporating experimental thermodynamic and kinetic data
Xiaojun Ji, Hao Wang, Wenjian Liu
Milestoning is an accurate and efficient method for rare event kinetics calculations by constructing a continuous-time kinetic network connecting the reactant and product states. H…
physics.chem-ph2024★ 1 cited
Kinetic network in Milestoning: Clustering, reduction, and transition path analysis
Ru Wang, Xiaojun Ji, Hao Wang +1
We present a reduction of Milestoning (ReM) algorithm to analyze the high-dimensional Milestoning kinetic network. The algorithm reduces the Milestoning network to low dimensions b…